AA39638
130636-60-1 | tert-Butyl 4-[2-(4-nitrophenyl)ethyl]piperazine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA39638
ChemicalName
tert-Butyl 4-[2-(4-nitrophenyl)ethyl]piperazine-1-carboxylate
CasNumber
130636-60-1
MolecularFormula
C17H25N3O4
MolecularWeight
335.3981
MdlNumber
MFCD12963748
Smiles
O=C(N1CCN(CC1)CCc1ccc(cc1)[N+](=O)[O-])OC(C)(C)C
Complexity
428
Covalently-bondedUnitCount
1
HeavyAtomCount
24
HydrogenBondAcceptorCount
5
RotatableBondCount
5
Xlogp3
2.7
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CatalogNumber: AA39638
ChemicalName: tert-Butyl 4-[2-(4-nitrophenyl)ethyl]piperazine-1-carboxylate
CasNumber: 130636-60-1
MolecularFormula: C17H25N3O4
MolecularWeight: 335.3981
MdlNumber: MFCD12963748
Smiles: O=C(N1CCN(CC1)CCc1ccc(cc1)[N+](=O)[O-])OC(C)(C)C
Complexity: 428
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 5
RotatableBondCount: 5
Xlogp3: 2.7
CatalogNumber:
AA39638
ChemicalName:
tert-Butyl 4-[2-(4-nitrophenyl)ethyl]piperazine-1-carboxylate
CasNumber:
130636-60-1
MolecularFormula:
C17H25N3O4
MolecularWeight:
335.3981
MdlNumber:
MFCD12963748
Smiles:
O=C(N1CCN(CC1)CCc1ccc(cc1)[N+](=O)[O-])OC(C)(C)C
Complexity:
428
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
5
RotatableBondCount:
5
Xlogp3:
2.7
CatalogNumber: __
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MolecularFormula: __
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Smiles: Nc1cccc2c1c(O)ccn2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
Nc1cccc2c1c(O)ccn2
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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ChemicalName: __
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MolecularFormula: __
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Smiles: Nc1ccc(cc1)Nc1ccc(cc1)Cl
Complexity: 182
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.4
CatalogNumber:
__
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
Nc1ccc(cc1)Nc1ccc(cc1)Cl
Complexity:
182
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.4
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Smiles: Cc1ccc(cc1N)S(=O)(=O)Nc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Cc1ccc(cc1N)S(=O)(=O)Nc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__